| CAS Number | 2246871-89-4 |
| Catalog Number | AG01FPUG(AGN-PC-3H5P5D) |
| Chemical Name | 2-methoxy-N-(2-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetamide |
| IUPAC Name | 2-methoxy-N-[2-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide |
| InChI | InChI=1S/C16H24BNO5/c1-15(2)16(3,4)23-17(22-15)11-7-8-12(13(9-11)21-6)18-14(19)10-20-5/h7-9H,10H2,1-6H3,(H,18,19) |
| InChI Key | ZMFXSERJBXGRDG-UHFFFAOYSA-N |
| MDL Number | MFCD32206512 |
| Molecular Formula | C16H24BNO5 |
| Molecular Weight | 321.1765 |
| SMILES | O=C(NC1=CC=C(B2OC(C)(C)C(C)(C)O2)C=C1OC)COC |
| Synonyms | AS-74134,
2-methoxy-N-[2-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide,
2246871-89-4,
|
| Complexity | 413 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 321.174753g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 321.2g/mol |
| Monoisotopic Mass | 321.174753g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 66Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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